CID 52562

Indole, 3-(n-(3-pyridyl)formimidoyl)-

Structural Information

Molecular Formula
C14H11N3
SMILES
C1=CC=C2C(=C1)C(=CN2)C=NC3=CN=CC=C3
InChI
InChI=1S/C14H11N3/c1-2-6-14-13(5-1)11(9-17-14)8-16-12-4-3-7-15-10-12/h1-10,17H
InChIKey
ORFGBHFBILRCNW-UHFFFAOYSA-N
Compound name
1-(1H-indol-3-yl)-N-pyridin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

14
Patents

221.09529 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.10257 148.1
[M+Na]+ 244.08451 163.7
[M+NH4]+ 239.12911 157.4
[M+K]+ 260.05845 156.5
[M-H]- 220.08801 153.0
[M+Na-2H]- 242.06996 158.8
[M]+ 221.09474 151.8
[M]- 221.09584 151.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe